3-[[1-(naphthalen-1-ylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylic acid

Systemtic Name: 3-[[1-(naphthalen-1-ylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylic acid Openeye Name: 3-[[1-benzyl-2-(1-naphthylamino)-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylic acid CAS Name: 3-[[[1-(1-naphthalenylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid IUPAC Name: 3-[[1-(naphthalen-1-ylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]aziridine-2-carboxylic acid Traditional Name: 3-[[1-benzyl-2-keto-2-(1-naphthylamino)ethyl]carbamoyl]ethylenimine-2-carboxylic acid Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=CC3=CC=CC=C32)NC(=O)C4C(N4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=CC=CC3=CC=CC=C32)NC(=O)C4C(N4)C(=O)O

InChI

InChI=1S/C23H21N3O4/c27-21(24-17-12-6-10-15-9-4-5-11-16(15)17)18(13-14-7-2-1-3-8-14)25-22(28)19-20(26-19)23(29)30/h1-12,18-20,26H,13H2,(H,24,27)(H,25,28)(H,29,30)