(3S)-3-(furan-2-ylmethylazaniumyl)-4-(naphthalen-2-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: (3S)-3-(furan-2-ylmethylazaniumyl)-4-(naphthalen-2-ylamino)-4-oxidanylidene-butanoate Openeye Name: (3S)-3-(2-furylmethylammonio)-4-(2-naphthylamino)-4-oxo-butanoate CAS Name: (3S)-3-(2-furanylmethylammonio)-4-(2-naphthalenylamino)-4-oxobutanoate IUPAC Name: (3S)-3-(furan-2-ylmethylazaniumyl)-4-(naphthalen-2-ylamino)-4-oxobutanoate Traditional Name: (3S)-3-(2-furfurylammonio)-4-keto-4-(2-naphthylamino)butyrate Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=O)C(CC(=O)[O-])[NH2+]CC3=CC=CO3

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)[C@H](CC(=O)[O-])[NH2+]CC3=CC=CO3

InChI

InChI=1S/C19H18N2O4/c22-18(23)11-17(20-12-16-6-3-9-25-16)19(24)21-15-8-7-13-4-1-2-5-14(13)10-15/h1-10,17,20H,11-12H2,(H,21,24)(H,22,23)/t17-/m0/s1