2-(1H-indol-3-yl)ethylazanium; (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: 2-(1H-indol-3-yl)ethylazanium; (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: 2-(1H-indol-3-yl)ethylammonium; (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: 2-(1H-indol-3-yl)ethylammonium; (E)-3-(3-nitrophenyl)-2-propenoate IUPAC Name: 2-(1H-indol-3-yl)ethylazanium; (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: 2-(1H-indol-3-yl)ethylammonium; (E)-3-(3-nitrophenyl)acrylate Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC[NH3+].C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC[NH3+].C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)[O-]

InChI

InChI=1S/C10H12N2.C9H7NO4/c11-6-5-8-7-12-10-4-2-1-3-9(8)10;11-9(12)5-4-7-2-1-3-8(6-7)10(13)14/h1-4,7,12H,5-6,11H2;1-6H,(H,11,12)/b;5-4+