(3S)-3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-3-(4-propoxyphenyl)propanoate

Systemtic Name: (3S)-3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-3-(4-propoxyphenyl)propanoate Openeye Name: (3S)-3-[(2-chloro-4-nitro-benzoyl)amino]-3-(4-propoxyphenyl)propanoate CAS Name: (3S)-3-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-3-(4-propoxyphenyl)propanoate IUPAC Name: (3S)-3-[(2-chloro-4-nitrobenzoyl)amino]-3-(4-propoxyphenyl)propanoate Traditional Name: (3S)-3-[(2-chloro-4-nitro-benzoyl)amino]-3-(4-propoxyphenyl)propionate Formula: C19H18ClN2O6- MolecularWeight: 405.80902

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@H](CC(=O)[O-])NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19ClN2O6/c1-2-9-28-14-6-3-12(4-7-14)17(11-18(23)24)21-19(25)15-8-5-13(22(26)27)10-16(15)20/h3-8,10,17H,2,9,11H2,1H3,(H,21,25)(H,23,24)/p-1/t17-/m0/s1