ethyl 2,4-dimethyl-3-[2-methylpropanoyl-(phenylmethyl)carbamoyl]pent-3-enoate

Systemtic Name: ethyl 2,4-dimethyl-3-[2-methylpropanoyl-(phenylmethyl)carbamoyl]pent-3-enoate Openeye Name: ethyl 3-[benzyl(2-methylpropanoyl)carbamoyl]-2,4-dimethyl-pent-3-enoate CAS Name: 2,4-dimethyl-3-[[(2-methyl-1-oxopropyl)-(phenylmethyl)amino]-oxomethyl]-3-pentenoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl(2-methylpropanoyl)carbamoyl]-2,4-dimethylpent-3-enoate Traditional Name: 3-[benzyl(isobutyryl)carbamoyl]-2,4-dimethyl-pent-3-enoic acid ethyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(=C(C)C)C(=O)N(CC1=CC=CC=C1)C(=O)C(C)C

Isomeric SMILES

CCOC(=O)C(C)C(=C(C)C)C(=O)N(CC1=CC=CC=C1)C(=O)C(C)C

InChI

InChI=1S/C21H29NO4/c1-7-26-21(25)16(6)18(14(2)3)20(24)22(19(23)15(4)5)13-17-11-9-8-10-12-17/h8-12,15-16H,7,13H2,1-6H3