(1-butylpiperidin-4-yl)methyl 2-methyl-4-oxidanylidene-1H-pyrimido[1,2-a]indole-10-carboxylate

Systemtic Name: (1-butylpiperidin-4-yl)methyl 2-methyl-4-oxidanylidene-1H-pyrimido[1,2-a]indole-10-carboxylate Openeye Name: (1-butyl-4-piperidyl)methyl 2-methyl-4-oxo-1H-pyrimido[1,2-a]indole-10-carboxylate CAS Name: 2-methyl-4-oxo-1H-pyrimido[1,2-a]indole-10-carboxylic acid (1-butyl-4-piperidinyl)methyl ester IUPAC Name: (1-butylpiperidin-4-yl)methyl 2-methyl-4-oxo-1H-pyrimido[1,2-a]indole-10-carboxylate Traditional Name: 4-keto-2-methyl-1H-pyrimid[1,2-a]indole-10-carboxylic acid (1-butyl-4-piperidyl)methyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)COC(=O)C2=C3NC(=CC(=O)N3C4=CC=CC=C42)C

Isomeric SMILES

CCCCN1CCC(CC1)COC(=O)C2=C3NC(=CC(=O)N3C4=CC=CC=C42)C

InChI

InChI=1S/C23H29N3O3/c1-3-4-11-25-12-9-17(10-13-25)15-29-23(28)21-18-7-5-6-8-19(18)26-20(27)14-16(2)24-22(21)26/h5-8,14,17,24H,3-4,9-13,15H2,1-2H3