methyl 2-[(3,5-dinitrophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[(3,5-dinitrophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[(3,5-dinitrobenzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[(3,5-dinitrobenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C19H16N4O7 MolecularWeight: 412.35294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O7/c1-30-19(25)17(8-12-10-20-16-5-3-2-4-15(12)16)21-18(24)11-6-13(22(26)27)9-14(7-11)23(28)29/h2-7,9-10,17,20H,8H2,1H3,(H,21,24)