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7-(5-nitroindol-1-yl)heptyl pyridine-3-carboxylate

7-(5-nitroindol-1-yl)heptyl pyridine-3-carboxylate

Systemtic Name:7-(5-nitroindol-1-yl)heptyl pyridine-3-carboxylate
Openeye Name:7-(5-nitroindol-1-yl)heptyl pyridine-3-carboxylate
CAS Name:3-pyridinecarboxylic acid 7-(5-nitro-1-indolyl)heptyl ester
IUPAC Name:7-(5-nitroindol-1-yl)heptyl pyridine-3-carboxylate
Traditional Name:nicotinic acid 7-(5-nitroindol-1-yl)heptyl ester
Formula: C21H23N3O4
MolecularWeight: 381.42502
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCCCCCCCN2C=CC3=C2C=CC(=C3)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCCCCCCCN2C=CC3=C2C=CC(=C3)[N+](=O)[O-]


InChI

InChI=1S/C21H23N3O4/c25-21(18-7-6-11-22-16-18)28-14-5-3-1-2-4-12-23-13-10-17-15-19(24(26)27)8-9-20(17)23/h6-11,13,15-16H,1-5,12,14H2


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