methyl 2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-[(phenylmethyl)amino]benzoate

Systemtic Name: methyl 2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-[(phenylmethyl)amino]benzoate Openeye Name: methyl 4-(benzylamino)-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoate CAS Name: 2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]-4-[(phenylmethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Traditional Name: 4-(benzylamino)-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid methyl ester Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)NCC2=CC=CC=C2)C(=O)OC)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=CC(=C1)NCC2=CC=CC=C2)C(=O)OC)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H26N2O3/c1-20(23-13-12-22-10-6-7-11-24(22)17-23)16-28(32)31-27-18-25(14-15-26(27)29(33)34-2)30-19-21-8-4-3-5-9-21/h3-18,30H,19H2,1-2H3,(H,31,32)/b20-16-