ethyl 4-methyl-3-[2-methylpropanoyl-(phenylmethyl)carbamoyl]-2-prop-2-enyl-pent-3-enoate

Systemtic Name: ethyl 4-methyl-3-[2-methylpropanoyl-(phenylmethyl)carbamoyl]-2-prop-2-enyl-pent-3-enoate Openeye Name: ethyl 2-allyl-3-[benzyl(2-methylpropanoyl)carbamoyl]-4-methyl-pent-3-enoate CAS Name: 4-methyl-3-[[(2-methyl-1-oxopropyl)-(phenylmethyl)amino]-oxomethyl]-2-prop-2-enyl-3-pentenoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl(2-methylpropanoyl)carbamoyl]-4-methyl-2-prop-2-enylpent-3-enoate Traditional Name: 2-allyl-3-[benzyl(isobutyryl)carbamoyl]-4-methyl-pent-3-enoic acid ethyl ester Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO4/c1-7-12-19(23(27)28-8-2)20(16(3)4)22(26)24(21(25)17(5)6)15-18-13-10-9-11-14-18/h7,9-11,13-14,17,19H,1,8,12,15H2,2-6H3