ethyl 4-[2-[(4-methoxycarbonylphenyl)methyl]-3-(naphthalen-2-ylamino)-3-oxidanylidene-propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-methoxycarbonylphenyl)methyl]-3-(naphthalen-2-ylamino)-3-oxidanylidene-propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-methoxycarbonylphenyl)methyl]-3-(2-naphthylamino)-3-oxo-propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[(4-methoxycarbonylphenyl)methyl]-3-(2-naphthalenylamino)-1,3-dioxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-methoxycarbonylphenyl)methyl]-3-(naphthalen-2-ylamino)-3-oxopropanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-carbomethoxybenzyl)-3-keto-3-(2-naphthylamino)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C29H31N3O6 MolecularWeight: 517.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)C(=O)OC)C(=O)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)C(=O)OC)C(=O)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H31N3O6/c1-3-38-29(36)32-16-14-31(15-17-32)27(34)25(18-20-8-10-22(11-9-20)28(35)37-2)26(33)30-24-13-12-21-6-4-5-7-23(21)19-24/h4-13,19,25H,3,14-18H2,1-2H3,(H,30,33)