sodium 3-[[3-naphthalen-2-yl-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]carbamoyl]aziridine-2-carboxylic acid

Systemtic Name: sodium 3-[[3-naphthalen-2-yl-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]carbamoyl]aziridine-2-carboxylic acid Openeye Name: sodium 3-[[2-(benzylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylic acid CAS Name: sodium 3-[[[3-(2-naphthalenyl)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid IUPAC Name: sodium 3-[[1-(benzylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]aziridine-2-carboxylic acid Traditional Name: sodium 3-[[2-(benzylamino)-2-keto-1-(2-naphthylmethyl)ethyl]carbamoyl]ethylenimine-2-carboxylic acid Formula: C24H23N3NaO4+ MolecularWeight: 440.44689

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C4C(N4)C(=O)O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C4C(N4)C(=O)O.[Na+]

InChI

InChI=1S/C24H23N3O4.Na/c28-22(25-14-15-6-2-1-3-7-15)19(26-23(29)20-21(27-20)24(30)31)13-16-10-11-17-8-4-5-9-18(17)12-16;/h1-12,19-21,27H,13-14H2,(H,25,28)(H,26,29)(H,30,31);/q;+1