piperidin-4-yl-[5-[(1-propan-2-ylpyrrolidin-3-yl)amino]-1H-indol-2-yl]methanone hydrochloride

Systemtic Name: piperidin-4-yl-[5-[(1-propan-2-ylpyrrolidin-3-yl)amino]-1H-indol-2-yl]methanone hydrochloride Openeye Name: [5-[(1-isopropylpyrrolidin-3-yl)amino]-1H-indol-2-yl]-(4-piperidyl)methanone hydrochloride CAS Name: 4-piperidinyl-[5-[(1-propan-2-yl-3-pyrrolidinyl)amino]-1H-indol-2-yl]methanone hydrochloride IUPAC Name: piperidin-4-yl-[5-[(1-propan-2-ylpyrrolidin-3-yl)amino]-1H-indol-2-yl]methanone hydrochloride Traditional Name: [5-[(1-isopropylpyrrolidin-3-yl)amino]-1H-indol-2-yl]-(4-piperidyl)methanone hydrochloride Formula: C42H61ClN8O2 MolecularWeight: 745.43914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(C1)NC2=CC3=C(C=C2)NC(=C3)C(=O)C4CCNCC4.CC(C)N1CCC(C1)NC2=CC3=C(C=C2)NC(=C3)C(=O)C4CCNCC4.Cl

Isomeric SMILES

CC(C)N1CCC(C1)NC2=CC3=C(C=C2)NC(=C3)C(=O)C4CCNCC4.CC(C)N1CCC(C1)NC2=CC3=C(C=C2)NC(=C3)C(=O)C4CCNCC4.Cl

InChI

InChI=1S/2C21H30N4O.ClH/c2*1-14(2)25-10-7-18(13-25)23-17-3-4-19-16(11-17)12-20(24-19)21(26)15-5-8-22-9-6-15;/h2*3-4,11-12,14-15,18,22-24H,5-10,13H2,1-2H3;1H