(2R)-2-[2-(cyclohexen-1-yl)ethylazaniumyl]-4-[(4-hydroxyphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-2-[2-(cyclohexen-1-yl)ethylazaniumyl]-4-[(4-hydroxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-2-[2-(cyclohexen-1-yl)ethylammonio]-4-(4-hydroxyanilino)-4-oxo-butanoate CAS Name: (2R)-2-[2-(1-cyclohexenyl)ethylammonio]-4-(4-hydroxyanilino)-4-oxobutanoate IUPAC Name: (2R)-2-[2-(cyclohexen-1-yl)ethylazaniumyl]-4-(4-hydroxyanilino)-4-oxobutanoate Traditional Name: (2R)-2-[2-(cyclohexen-1-yl)ethylammonio]-4-(4-hydroxyanilino)-4-keto-butyrate Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC[NH2+]C(CC(=O)NC2=CC=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

C1CCC(=CC1)CC[NH2+][C@H](CC(=O)NC2=CC=C(C=C2)O)C(=O)[O-]

InChI

InChI=1S/C18H24N2O4/c21-15-8-6-14(7-9-15)20-17(22)12-16(18(23)24)19-11-10-13-4-2-1-3-5-13/h4,6-9,16,19,21H,1-3,5,10-12H2,(H,20,22)(H,23,24)/t16-/m1/s1