ethyl (E)-4-[(3,5-dimethylphenyl)carbamoylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate

Systemtic Name: ethyl (E)-4-[(3,5-dimethylphenyl)carbamoylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate Openeye Name: ethyl (E)-4-[(3,5-dimethylphenyl)carbamoylamino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate CAS Name: (E)-4-[[(3,5-dimethylanilino)-oxomethyl]amino]-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(3,5-dimethylphenyl)carbamoylamino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate Traditional Name: (E)-4-[(3,5-dimethylphenyl)carbamoylamino]-5-(2-ketopyrrolidin-3-yl)pent-2-enoic acid ethyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NC(=O)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)/C=C/C(CC1CCNC1=O)NC(=O)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H27N3O4/c1-4-27-18(24)6-5-16(12-15-7-8-21-19(15)25)22-20(26)23-17-10-13(2)9-14(3)11-17/h5-6,9-11,15-16H,4,7-8,12H2,1-3H3,(H,21,25)(H2,22,23,26)/b6-5+