2-(5-nitroindol-1-yl)ethyl pyridine-3-carboxylate

Systemtic Name: 2-(5-nitroindol-1-yl)ethyl pyridine-3-carboxylate Openeye Name: 2-(5-nitroindol-1-yl)ethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 2-(5-nitro-1-indolyl)ethyl ester IUPAC Name: 2-(5-nitroindol-1-yl)ethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 2-(5-nitroindol-1-yl)ethyl ester Formula: C16H13N3O4 MolecularWeight: 311.29212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCCN2C=CC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCCN2C=CC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c20-16(13-2-1-6-17-11-13)23-9-8-18-7-5-12-10-14(19(21)22)3-4-15(12)18/h1-7,10-11H,8-9H2