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

Systemtic Name: ethyl 3-[[1-[methyl(naphthalen-1-ylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-[methyl(1-naphthylmethyl)amino]-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[1-[methyl(1-naphthalenylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-[methyl(naphthalen-1-ylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[1-benzyl-2-keto-2-[methyl(1-naphthylmethyl)amino]ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)N(C)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)N(C)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H29N3O4/c1-3-34-27(33)24-23(29-24)25(31)28-22(16-18-10-5-4-6-11-18)26(32)30(2)17-20-14-9-13-19-12-7-8-15-21(19)20/h4-15,22-24,29H,3,16-17H2,1-2H3,(H,28,31)