ethyl 3-[[3-naphthalen-2-yl-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]carbamoyl]aziridine-2-carboxylate

Systemtic Name: ethyl 3-[[3-naphthalen-2-yl-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[2-(benzylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[3-(2-naphthalenyl)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(benzylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[2-(benzylamino)-2-keto-1-(2-naphthylmethyl)ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4/c1-2-33-26(32)23-22(29-23)25(31)28-21(24(30)27-16-17-8-4-3-5-9-17)15-18-12-13-19-10-6-7-11-20(19)14-18/h3-14,21-23,29H,2,15-16H2,1H3,(H,27,30)(H,28,31)