(2S)-1-ethanoyl-2-(3-methylbut-2-enyl)-2-[(4-nitrophenyl)methyl]indol-3-one

Systemtic Name: (2S)-1-ethanoyl-2-(3-methylbut-2-enyl)-2-[(4-nitrophenyl)methyl]indol-3-one Openeye Name: (2S)-1-acetyl-2-(3-methylbut-2-enyl)-2-[(4-nitrophenyl)methyl]indolin-3-one CAS Name: (2S)-1-acetyl-2-(3-methylbut-2-enyl)-2-[(4-nitrophenyl)methyl]-3-indolone IUPAC Name: (2S)-1-acetyl-2-(3-methylbut-2-enyl)-2-[(4-nitrophenyl)methyl]indol-3-one Traditional Name: (2S)-1-acetyl-2-(3-methylbut-2-enyl)-2-(4-nitrobenzyl)pseudoindoxyl Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1(C(=O)C2=CC=CC=C2N1C(=O)C)CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC(=CC[C@@]1(C(=O)C2=CC=CC=C2N1C(=O)C)CC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H22N2O4/c1-15(2)12-13-22(14-17-8-10-18(11-9-17)24(27)28)21(26)19-6-4-5-7-20(19)23(22)16(3)25/h4-12H,13-14H2,1-3H3/t22-/m0/s1