N,N'-bis[1-[(4-aminophenyl)methyl]-2-oxidanylidene-piperidin-3-yl]heptanediamide

Systemtic Name: N,N'-bis[1-[(4-aminophenyl)methyl]-2-oxidanylidene-piperidin-3-yl]heptanediamide Openeye Name: N,N'-bis[1-[(4-aminophenyl)methyl]-2-oxo-3-piperidyl]heptanediamide CAS Name: N,N'-bis[1-[(4-aminophenyl)methyl]-2-oxo-3-piperidinyl]heptanediamide IUPAC Name: N,N'-bis[1-[(4-aminophenyl)methyl]-2-oxopiperidin-3-yl]heptanediamide Traditional Name: N,N'-bis[1-(4-aminobenzyl)-2-keto-3-piperidyl]pimelamide Formula: C31H42N6O4 MolecularWeight: 562.70298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC2=CC=C(C=C2)N)NC(=O)CCCCCC(=O)NC3CCCN(C3=O)CC4=CC=C(C=C4)N

Isomeric SMILES

C1CC(C(=O)N(C1)CC2=CC=C(C=C2)N)NC(=O)CCCCCC(=O)NC3CCCN(C3=O)CC4=CC=C(C=C4)N

InChI

InChI=1S/C31H42N6O4/c32-24-14-10-22(11-15-24)20-36-18-4-6-26(30(36)40)34-28(38)8-2-1-3-9-29(39)35-27-7-5-19-37(31(27)41)21-23-12-16-25(33)17-13-23/h10-17,26-27H,1-9,18-21,32-33H2,(H,34,38)(H,35,39)