3-(2-hydroxyethyl)-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]indole-5-carboximidamide

Systemtic Name: 3-(2-hydroxyethyl)-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]indole-5-carboximidamide Openeye Name: 1-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-3-(2-hydroxyethyl)indole-5-carboxamidine CAS Name: 3-(2-hydroxyethyl)-1-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-5-indolecarboximidamide IUPAC Name: 1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3-(2-hydroxyethyl)indole-5-carboximidamide Traditional Name: 1-[2-(4-benzylpiperidino)-2-keto-ethyl]-3-(2-hydroxyethyl)indole-5-carboxamidine Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=C(C4=C3C=CC(=C4)C(=N)N)CCO

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=C(C4=C3C=CC(=C4)C(=N)N)CCO

InChI

InChI=1S/C25H30N4O2/c26-25(27)20-6-7-23-22(15-20)21(10-13-30)16-29(23)17-24(31)28-11-8-19(9-12-28)14-18-4-2-1-3-5-18/h1-7,15-16,19,30H,8-14,17H2,(H3,26,27)