[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 4-(hydroxymethyl)benzoate

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 4-(hydroxymethyl)benzoate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] 4-(hydroxymethyl)benzoate CAS Name: 4-(hydroxymethyl)benzoic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] 4-(hydroxymethyl)benzoate Traditional Name: 4-methylolbenzoic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C25H25NO4 MolecularWeight: 403.4703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC(=O)COC(=O)C2=CC=C(C=C2)CO)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC(=O)COC(=O)C2=CC=C(C=C2)CO)C3=CC=CC=C3

InChI

InChI=1S/C25H25NO4/c27-17-19-11-13-22(14-12-19)25(29)30-18-24(28)26-16-15-23(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-14,23,27H,15-18H2,(H,26,28)