ethyl 4-[(E)-2-benzamido-3-(4-dimethylaminophenyl)prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(E)-2-benzamido-3-(4-dimethylaminophenyl)prop-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(E)-2-benzamido-3-(4-dimethylaminophenyl)prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-2-benzamido-3-(4-dimethylaminophenyl)-1-oxoprop-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-benzamido-3-(4-dimethylaminophenyl)prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-2-benzamido-3-(4-dimethylaminophenyl)acryloyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(=CC2=CC=C(C=C2)N(C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)/C(=C\C2=CC=C(C=C2)N(C)C)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H30N4O4/c1-4-33-25(32)29-16-14-28(15-17-29)24(31)22(26-23(30)20-8-6-5-7-9-20)18-19-10-12-21(13-11-19)27(2)3/h5-13,18H,4,14-17H2,1-3H3,(H,26,30)/b22-18+