methyl 2-[2-azanyl-1-[2-butyl-4-[(3-phenylphenyl)methyl]phenyl]-1-oxidanyl-2-oxidanylidene-ethoxy]nonanoate

Systemtic Name: methyl 2-[2-azanyl-1-[2-butyl-4-[(3-phenylphenyl)methyl]phenyl]-1-oxidanyl-2-oxidanylidene-ethoxy]nonanoate Openeye Name: methyl 2-[2-amino-1-[2-butyl-4-[(3-phenylphenyl)methyl]phenyl]-1-hydroxy-2-oxo-ethoxy]nonanoate CAS Name: 2-[2-amino-1-[2-butyl-4-[(3-phenylphenyl)methyl]phenyl]-1-hydroxy-2-oxoethoxy]nonanoic acid methyl ester IUPAC Name: methyl 2-[2-amino-1-[2-butyl-4-[(3-phenylphenyl)methyl]phenyl]-1-hydroxy-2-oxoethoxy]nonanoate Traditional Name: 2-[2-amino-1-[2-butyl-4-(3-phenylbenzyl)phenyl]-1-hydroxy-2-keto-ethoxy]pelargonic acid methyl ester Formula: C35H45NO5 MolecularWeight: 559.7355

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(=O)OC)OC(C1=C(C=C(C=C1)CC2=CC=CC(=C2)C3=CC=CC=C3)CCCC)(C(=O)N)O

Isomeric SMILES

CCCCCCCC(C(=O)OC)OC(C1=C(C=C(C=C1)CC2=CC=CC(=C2)C3=CC=CC=C3)CCCC)(C(=O)N)O

InChI

InChI=1S/C35H45NO5/c1-4-6-8-9-13-20-32(33(37)40-3)41-35(39,34(36)38)31-22-21-27(25-30(31)16-7-5-2)23-26-15-14-19-29(24-26)28-17-11-10-12-18-28/h10-12,14-15,17-19,21-22,24-25,32,39H,4-9,13,16,20,23H2,1-3H3,(H2,36,38)