6-[4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazin-1-yl]carbonyloxyhexa-2,4-diynyl 4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: 6-[4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazin-1-yl]carbonyloxyhexa-2,4-diynyl 4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylate Openeye Name: 6-[4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazine-1-carbonyl]oxyhexa-2,4-diynyl 4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[[[3-(aminomethyl)phenyl]methylamino]-oxomethyl]-1-piperazinecarboxylic acid 6-[[4-[[[3-(aminomethyl)phenyl]methylamino]-oxomethyl]-1-piperazinyl]-oxomethoxy]hexa-2,4-diynyl ester IUPAC Name: 6-[4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazine-1-carbonyl]oxyhexa-2,4-diynyl 4-[[3-(aminomethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(aminomethyl)benzyl]carbamoyl]piperazine-1-carboxylic acid 6-[4-[[3-(aminomethyl)benzyl]carbamoyl]piperazine-1-carbonyl]oxyhexa-2,4-diynyl ester Formula: C34H42N8O6 MolecularWeight: 658.74728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC=CC(=C2)CN)C(=O)OCC#CC#CCOC(=O)N3CCN(CC3)C(=O)NCC4=CC=CC(=C4)CN

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC=CC(=C2)CN)C(=O)OCC#CC#CCOC(=O)N3CCN(CC3)C(=O)NCC4=CC=CC(=C4)CN

InChI

InChI=1S/C34H42N8O6/c35-23-27-7-5-9-29(21-27)25-37-31(43)39-11-15-41(16-12-39)33(45)47-19-3-1-2-4-20-48-34(46)42-17-13-40(14-18-42)32(44)38-26-30-10-6-8-28(22-30)24-36/h5-10,21-22H,11-20,23-26,35-36H2,(H,37,43)(H,38,44)