methyl 4-[(E)-3-oxidanylidene-3-[(2-pyrrolidin-1-ylphenyl)amino]prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-oxidanylidene-3-[(2-pyrrolidin-1-ylphenyl)amino]prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-oxo-3-(2-pyrrolidin-1-ylanilino)prop-1-enyl]benzoate CAS Name: 4-[(E)-3-oxo-3-[2-(1-pyrrolidinyl)anilino]prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-oxo-3-(2-pyrrolidin-1-ylanilino)prop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-(2-pyrrolidinoanilino)prop-1-enyl]benzoic acid methyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=CC=CC=C2N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2N3CCCC3

InChI

InChI=1S/C21H22N2O3/c1-26-21(25)17-11-8-16(9-12-17)10-13-20(24)22-18-6-2-3-7-19(18)23-14-4-5-15-23/h2-3,6-13H,4-5,14-15H2,1H3,(H,22,24)/b13-10+