4-(3,3-diphenylpropylamino)-3-[(3-methoxy-3-oxidanylidene-propanoyl)amino]benzoic acid

Systemtic Name: 4-(3,3-diphenylpropylamino)-3-[(3-methoxy-3-oxidanylidene-propanoyl)amino]benzoic acid Openeye Name: 4-(3,3-diphenylpropylamino)-3-[(3-methoxy-3-oxo-propanoyl)amino]benzoic acid CAS Name: 4-(3,3-diphenylpropylamino)-3-[(3-methoxy-1,3-dioxopropyl)amino]benzoic acid IUPAC Name: 4-(3,3-diphenylpropylamino)-3-[(3-methoxy-3-oxopropanoyl)amino]benzoic acid Traditional Name: 4-(3,3-diphenylpropylamino)-3-[(3-keto-3-methoxy-propanoyl)amino]benzoic acid Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)NC1=C(C=CC(=C1)C(=O)O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CC(=O)NC1=C(C=CC(=C1)C(=O)O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H26N2O5/c1-33-25(30)17-24(29)28-23-16-20(26(31)32)12-13-22(23)27-15-14-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-13,16,21,27H,14-15,17H2,1H3,(H,28,29)(H,31,32)