[2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] 2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] 2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] 2-(benzyloxycarbonylamino)acetate CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid [2-tert-butyl-6-[[[N-cycloheptyl-4-(dimethylamino)anilino]-oxomethyl]amino]-4-methoxyphenyl] ester IUPAC Name: [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxyphenyl] 2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)acetic acid [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] ester Formula: C37H48N4O6 MolecularWeight: 644.80022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC(=O)CNC(=O)OCC2=CC=CC=C2)NC(=O)N(C3CCCCCC3)C4=CC=C(C=C4)N(C)C)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC(=O)CNC(=O)OCC2=CC=CC=C2)NC(=O)N(C3CCCCCC3)C4=CC=C(C=C4)N(C)C)OC

InChI

InChI=1S/C37H48N4O6/c1-37(2,3)31-22-30(45-6)23-32(34(31)47-33(42)24-38-36(44)46-25-26-14-10-9-11-15-26)39-35(43)41(28-16-12-7-8-13-17-28)29-20-18-27(19-21-29)40(4)5/h9-11,14-15,18-23,28H,7-8,12-13,16-17,24-25H2,1-6H3,(H,38,44)(H,39,43)