3-(3-azanylpropyl)-1-(1H-indol-3-yl)-4-[(E)-2-nitroethenyl]pyrrole-2,5-dione

Systemtic Name: 3-(3-azanylpropyl)-1-(1H-indol-3-yl)-4-[(E)-2-nitroethenyl]pyrrole-2,5-dione Openeye Name: 3-(3-aminopropyl)-1-(1H-indol-3-yl)-4-[(E)-2-nitrovinyl]pyrrole-2,5-dione CAS Name: 3-(3-aminopropyl)-1-(1H-indol-3-yl)-4-[(E)-2-nitroethenyl]pyrrole-2,5-dione IUPAC Name: 3-(3-aminopropyl)-1-(1H-indol-3-yl)-4-[(E)-2-nitroethenyl]pyrrole-2,5-dione Traditional Name: 3-(3-aminopropyl)-1-(1H-indol-3-yl)-4-[(E)-2-nitrovinyl]-3-pyrroline-2,5-quinone Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)N3C(=O)C(=C(C3=O)C=C[N+](=O)[O-])CCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)N3C(=O)C(=C(C3=O)/C=C/[N+](=O)[O-])CCCN

InChI

InChI=1S/C17H16N4O4/c18-8-3-5-11-12(7-9-20(24)25)17(23)21(16(11)22)15-10-19-14-6-2-1-4-13(14)15/h1-2,4,6-7,9-10,19H,3,5,8,18H2/b9-7+