ethyl 2-[[(Z)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[(Z)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[(Z)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[(Z)-2-benzamido-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[(Z)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[(Z)-2-benzamido-3-(4-bromophenyl)acryloyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C27H25BrN2O4 MolecularWeight: 521.4024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C(=CC2=CC=C(C=C2)Br)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)/C(=C/C2=CC=C(C=C2)Br)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H25BrN2O4/c1-2-34-27(33)24(18-19-9-5-3-6-10-19)30-26(32)23(17-20-13-15-22(28)16-14-20)29-25(31)21-11-7-4-8-12-21/h3-17,24H,2,18H2,1H3,(H,29,31)(H,30,32)/b23-17-