(3S,4S)-4-(1-methylindol-3-yl)-3-nitro-4-phenyl-butan-2-one

Systemtic Name: (3S,4S)-4-(1-methylindol-3-yl)-3-nitro-4-phenyl-butan-2-one Openeye Name: (3S,4S)-4-(1-methylindol-3-yl)-3-nitro-4-phenyl-butan-2-one CAS Name: (3S,4S)-4-(1-methyl-3-indolyl)-3-nitro-4-phenyl-2-butanone IUPAC Name: (3S,4S)-4-(1-methylindol-3-yl)-3-nitro-4-phenylbutan-2-one Traditional Name: (3S,4S)-4-(1-methylindol-3-yl)-3-nitro-4-phenyl-butan-2-one Formula: C19H18N2O3 MolecularWeight: 322.35782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1=CC=CC=C1)C2=CN(C3=CC=CC=C32)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)[C@H]([C@@H](C1=CC=CC=C1)C2=CN(C3=CC=CC=C32)C)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O3/c1-13(22)19(21(23)24)18(14-8-4-3-5-9-14)16-12-20(2)17-11-7-6-10-15(16)17/h3-12,18-19H,1-2H3/t18-,19+/m0/s1