ethyl 2-cyano-3-(naphthalen-1-ylamino)-2-(naphthalen-1-ylcarbamoyl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 2-cyano-3-(naphthalen-1-ylamino)-2-(naphthalen-1-ylcarbamoyl)-3-oxidanylidene-propanoate Openeye Name: ethyl 2-cyano-3-(1-naphthylamino)-2-(1-naphthylcarbamoyl)-3-oxo-propanoate CAS Name: 2-cyano-3-(1-naphthalenylamino)-2-[(1-naphthalenylamino)-oxomethyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-(naphthalen-1-ylamino)-2-(naphthalen-1-ylcarbamoyl)-3-oxopropanoate Traditional Name: 2-cyano-3-keto-3-(1-naphthylamino)-2-(1-naphthylcarbamoyl)propionic acid ethyl ester Formula: C27H21N3O4 MolecularWeight: 451.47334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)(C(=O)NC1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C(C#N)(C(=O)NC1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H21N3O4/c1-2-34-26(33)27(17-28,24(31)29-22-15-7-11-18-9-3-5-13-20(18)22)25(32)30-23-16-8-12-19-10-4-6-14-21(19)23/h3-16H,2H2,1H3,(H,29,31)(H,30,32)