N-[3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]propyl]-1H-indole-2-carboxamide

Systemtic Name: N-[3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]propyl]-1H-indole-2-carboxamide Openeye Name: N-[3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]propyl]-1H-indole-2-carboxamide CAS Name: N-[3-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]propyl]-1H-indole-2-carboxamide IUPAC Name: N-[3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]propyl]-1H-indole-2-carboxamide Traditional Name: N-[3-[[(E)-3-(3-nitrophenyl)acryloyl]amino]propyl]-1H-indole-2-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2)C(=O)NCCCNC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)C(=O)NCCCNC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4/c26-20(10-9-15-5-3-7-17(13-15)25(28)29)22-11-4-12-23-21(27)19-14-16-6-1-2-8-18(16)24-19/h1-3,5-10,13-14,24H,4,11-12H2,(H,22,26)(H,23,27)/b10-9+