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

Systemtic Name: ethyl 3-[[1-(naphthalen-1-ylmethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-1-(phenylmethyl)aziridine-2-carboxylate Openeye Name: ethyl 1-benzyl-3-[[1-benzyl-2-(1-naphthylmethylamino)-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[1-(1-naphthalenylmethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1-(phenylmethyl)-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-[[1-(naphthalen-1-ylmethylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 1-benzyl-3-[[1-benzyl-2-keto-2-(1-naphthylmethylamino)ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C33H33N3O4 MolecularWeight: 535.63282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)NCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1C(N1CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)NCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C33H33N3O4/c1-2-40-33(39)30-29(36(30)22-24-14-7-4-8-15-24)32(38)35-28(20-23-12-5-3-6-13-23)31(37)34-21-26-18-11-17-25-16-9-10-19-27(25)26/h3-19,28-30H,2,20-22H2,1H3,(H,34,37)(H,35,38)