3-(1H-indol-3-yl)-N-[(Z)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]propanamide

Systemtic Name: 3-(1H-indol-3-yl)-N-[(Z)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]propanamide Openeye Name: 3-(1H-indol-3-yl)-N-[(Z)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]propanamide CAS Name: 3-(1H-indol-3-yl)-N-[(Z)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]propanamide IUPAC Name: 3-(1H-indol-3-yl)-N-[(Z)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]propanamide Traditional Name: 3-(1H-indol-3-yl)-N-[(Z)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]propionamide Formula: C16H17N7O3 MolecularWeight: 355.35128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CCC1=CNC2=CC=CC=C21)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)CCC1=CNC2=CC=CC=C21)/CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O3/c1-11(9-22-10-18-16(21-22)23(25)26)19-20-15(24)7-6-12-8-17-14-5-3-2-4-13(12)14/h2-5,8,10,17H,6-7,9H2,1H3,(H,20,24)/b19-11-