1-[(2,5-dimethylphenyl)methyl]-3-[(E)-2-nitroprop-1-enyl]indole

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-3-[(E)-2-nitroprop-1-enyl]indole Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-3-[(E)-2-nitroprop-1-enyl]indole CAS Name: 1-[(2,5-dimethylphenyl)methyl]-3-[(E)-2-nitroprop-1-enyl]indole IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-3-[(E)-2-nitroprop-1-enyl]indole Traditional Name: 1-(2,5-dimethylbenzyl)-3-[(E)-2-nitroprop-1-enyl]indole Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C=C(C3=CC=CC=C32)C=C(C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C=C(C3=CC=CC=C32)/C=C(\C)/[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O2/c1-14-8-9-15(2)17(10-14)12-21-13-18(11-16(3)22(23)24)19-6-4-5-7-20(19)21/h4-11,13H,12H2,1-3H3/b16-11+