3-piperidin-1-ylpropyl 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride

Systemtic Name: 3-piperidin-1-ylpropyl 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride Openeye Name: 3-(1-piperidyl)propyl 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate hydrochloride CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid 3-(1-piperidinyl)propyl ester hydrochloride IUPAC Name: 3-piperidin-1-ylpropyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate hydrochloride Traditional Name: 4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid 3-piperidinopropyl ester hydrochloride Formula: C25H28ClNO4 MolecularWeight: 441.94712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCCN3CCCCC3)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCCN3CCCCC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H27NO4.ClH/c1-18-22(27)20-12-8-13-21(24(20)30-23(18)19-10-4-2-5-11-19)25(28)29-17-9-16-26-14-6-3-7-15-26;/h2,4-5,8,10-13H,3,6-7,9,14-17H2,1H3;1H