ethyl 3-[[(Z)-2-acetamido-3-(2-methylphenyl)prop-2-enoyl]-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[[(Z)-2-acetamido-3-(2-methylphenyl)prop-2-enoyl]-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[[(Z)-2-acetamido-3-(o-tolyl)prop-2-enoyl]-benzyl-amino]propanoate CAS Name: 3-[[(Z)-2-acetamido-3-(2-methylphenyl)-1-oxoprop-2-enyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[(Z)-2-acetamido-3-(2-methylphenyl)prop-2-enoyl]-benzylamino]propanoate Traditional Name: 3-[[(Z)-2-acetamido-3-(o-tolyl)acryloyl]-benzyl-amino]propionic acid ethyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C(=CC2=CC=CC=C2C)NC(=O)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)/C(=C/C2=CC=CC=C2C)/NC(=O)C

InChI

InChI=1S/C24H28N2O4/c1-4-30-23(28)14-15-26(17-20-11-6-5-7-12-20)24(29)22(25-19(3)27)16-21-13-9-8-10-18(21)2/h5-13,16H,4,14-15,17H2,1-3H3,(H,25,27)/b22-16-