N-[(2-methyl-1H-indol-3-yl)-pyridin-4-yl-methyl]-3-nitro-aniline

Systemtic Name: N-[(2-methyl-1H-indol-3-yl)-pyridin-4-yl-methyl]-3-nitro-aniline Openeye Name: N-[(2-methyl-1H-indol-3-yl)-(4-pyridyl)methyl]-3-nitro-aniline CAS Name: N-[(2-methyl-1H-indol-3-yl)-pyridin-4-ylmethyl]-3-nitroaniline IUPAC Name: N-[(2-methyl-1H-indol-3-yl)-pyridin-4-ylmethyl]-3-nitroaniline Traditional Name: [(2-methyl-1H-indol-3-yl)-(4-pyridyl)methyl]-(3-nitrophenyl)amine Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=CC=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(C3=CC=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O2/c1-14-20(18-7-2-3-8-19(18)23-14)21(15-9-11-22-12-10-15)24-16-5-4-6-17(13-16)25(26)27/h2-13,21,23-24H,1H3