2-[bis(phenylmethyl)amino]ethyl (E)-4-(4-methoxyphenyl)-4-oxidanylidene-but-2-enoate

Systemtic Name: 2-[bis(phenylmethyl)amino]ethyl (E)-4-(4-methoxyphenyl)-4-oxidanylidene-but-2-enoate Openeye Name: 2-(dibenzylamino)ethyl (E)-4-(4-methoxyphenyl)-4-oxo-but-2-enoate CAS Name: (E)-4-(4-methoxyphenyl)-4-oxo-2-butenoic acid 2-[bis(phenylmethyl)amino]ethyl ester IUPAC Name: 2-(dibenzylamino)ethyl (E)-4-(4-methoxyphenyl)-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-(4-methoxyphenyl)but-2-enoic acid 2-(dibenzylamino)ethyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C=CC(=O)OCCN(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C=C/C(=O)OCCN(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H27NO4/c1-31-25-14-12-24(13-15-25)26(29)16-17-27(30)32-19-18-28(20-22-8-4-2-5-9-22)21-23-10-6-3-7-11-23/h2-17H,18-21H2,1H3/b17-16+