N-(3-indol-1-ylpropyl)-2,4-dinitro-aniline

Systemtic Name: N-(3-indol-1-ylpropyl)-2,4-dinitro-aniline Openeye Name: N-(3-indol-1-ylpropyl)-2,4-dinitro-aniline CAS Name: N-[3-(1-indolyl)propyl]-2,4-dinitroaniline IUPAC Name: N-(3-indol-1-ylpropyl)-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-(3-indol-1-ylpropyl)amine Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCCNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCCNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4/c22-20(23)14-6-7-15(17(12-14)21(24)25)18-9-3-10-19-11-8-13-4-1-2-5-16(13)19/h1-2,4-8,11-12,18H,3,9-10H2