2-[5-methoxy-2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]ethanenitrile

Systemtic Name: 2-[5-methoxy-2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]ethanenitrile Openeye Name: 2-[5-methoxy-2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]acetonitrile CAS Name: 2-[5-methoxy-2-methyl-1-[(4-nitrophenyl)methyl]-3-indolyl]acetonitrile IUPAC Name: 2-[5-methoxy-2-methyl-1-[(4-nitrophenyl)methyl]indol-3-yl]acetonitrile Traditional Name: 2-[5-methoxy-2-methyl-1-(4-nitrobenzyl)indol-3-yl]acetonitrile Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)[N+](=O)[O-])C=CC(=C2)OC)CC#N

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)[N+](=O)[O-])C=CC(=C2)OC)CC#N

InChI

InChI=1S/C19H17N3O3/c1-13-17(9-10-20)18-11-16(25-2)7-8-19(18)21(13)12-14-3-5-15(6-4-14)22(23)24/h3-8,11H,9,12H2,1-2H3