N-[3-(1H-indol-3-yl)propyl]pyridine-4-carboxamide hydrate hydrochloride

Systemtic Name: N-[3-(1H-indol-3-yl)propyl]pyridine-4-carboxamide hydrate hydrochloride Openeye Name: N-[3-(1H-indol-3-yl)propyl]pyridine-4-carboxamide hydrate hydrochloride CAS Name: N-[3-(1H-indol-3-yl)propyl]-4-pyridinecarboxamide hydrate hydrochloride IUPAC Name: N-[3-(1H-indol-3-yl)propyl]pyridine-4-carboxamide hydrate hydrochloride Traditional Name: N-[3-(1H-indol-3-yl)propyl]isonicotinamide hydrate hydrochloride Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCNC(=O)C3=CC=NC=C3.O.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCNC(=O)C3=CC=NC=C3.O.Cl

InChI

InChI=1S/C17H17N3O.ClH.H2O/c21-17(13-7-10-18-11-8-13)19-9-3-4-14-12-20-16-6-2-1-5-15(14)16;;/h1-2,5-8,10-12,20H,3-4,9H2,(H,19,21);1H;1H2