(butanoylamino) 4-[7-azanyl-1,1-bis(4-methoxyphenyl)-2-oxidanyl-heptyl]benzoate

Systemtic Name: (butanoylamino) 4-[7-azanyl-1,1-bis(4-methoxyphenyl)-2-oxidanyl-heptyl]benzoate Openeye Name: (butanoylamino) 4-[7-amino-2-hydroxy-1,1-bis(4-methoxyphenyl)heptyl]benzoate CAS Name: 4-[7-amino-2-hydroxy-1,1-bis(4-methoxyphenyl)heptyl]benzoic acid (1-oxobutylamino) ester IUPAC Name: (butanoylamino) 4-[7-amino-2-hydroxy-1,1-bis(4-methoxyphenyl)heptyl]benzoate Traditional Name: 4-[7-amino-2-hydroxy-1,1-bis(4-methoxyphenyl)heptyl]benzoic acid butyramido ester Formula: C32H40N2O6 MolecularWeight: 548.6698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NOC(=O)C1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)C(CCCCCN)O

Isomeric SMILES

CCCC(=O)NOC(=O)C1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)C(CCCCCN)O

InChI

InChI=1S/C32H40N2O6/c1-4-8-30(36)34-40-31(37)23-10-12-24(13-11-23)32(29(35)9-6-5-7-22-33,25-14-18-27(38-2)19-15-25)26-16-20-28(39-3)21-17-26/h10-21,29,35H,4-9,22,33H2,1-3H3,(H,34,36)