3-(2-azanylethyl)-N-(2-oxidanylidene-2-phenylazanyl-ethyl)-1H-indole-5-carboxamide hydrate hydrochloride

Systemtic Name: 3-(2-azanylethyl)-N-(2-oxidanylidene-2-phenylazanyl-ethyl)-1H-indole-5-carboxamide hydrate hydrochloride Openeye Name: 3-(2-aminoethyl)-N-(2-anilino-2-oxo-ethyl)-1H-indole-5-carboxamide hydrate hydrochloride CAS Name: 3-(2-aminoethyl)-N-(2-anilino-2-oxoethyl)-1H-indole-5-carboxamide hydrate hydrochloride IUPAC Name: 3-(2-aminoethyl)-N-(2-anilino-2-oxoethyl)-1H-indole-5-carboxamide hydrate hydrochloride Traditional Name: 3-(2-aminoethyl)-N-(2-anilino-2-keto-ethyl)-1H-indole-5-carboxamide hydrate hydrochloride Formula: C19H23ClN4O3 MolecularWeight: 390.86392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC3=C(C=C2)NC=C3CCN.O.Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC3=C(C=C2)NC=C3CCN.O.Cl

InChI

InChI=1S/C19H20N4O2.ClH.H2O/c20-9-8-14-11-21-17-7-6-13(10-16(14)17)19(25)22-12-18(24)23-15-4-2-1-3-5-15;;/h1-7,10-11,21H,8-9,12,20H2,(H,22,25)(H,23,24);1H;1H2