methyl 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methyl-pentanoate CAS Name: 2-[[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-4-methylpentanoate Traditional Name: 2-(homoveratrylcarbamoylamino)-4-methyl-valeric acid methyl ester Formula: C18H28N2O5 MolecularWeight: 352.42532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)NCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)NCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C18H28N2O5/c1-12(2)10-14(17(21)25-5)20-18(22)19-9-8-13-6-7-15(23-3)16(11-13)24-4/h6-7,11-12,14H,8-10H2,1-5H3,(H2,19,20,22)