4-[(4-butoxyphenyl)methyl-piperidin-4-yl-amino]-6-methoxy-chromen-2-one

Systemtic Name: 4-[(4-butoxyphenyl)methyl-piperidin-4-yl-amino]-6-methoxy-chromen-2-one Openeye Name: 4-[(4-butoxyphenyl)methyl-(4-piperidyl)amino]-6-methoxy-chromen-2-one CAS Name: 4-[(4-butoxyphenyl)methyl-(4-piperidinyl)amino]-6-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(4-butoxyphenyl)methyl-piperidin-4-ylamino]-6-methoxychromen-2-one Traditional Name: 4-[(4-butoxybenzyl)-(4-piperidyl)amino]-6-methoxy-coumarin Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN(C2CCNCC2)C3=CC(=O)OC4=C3C=C(C=C4)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN(C2CCNCC2)C3=CC(=O)OC4=C3C=C(C=C4)OC

InChI

InChI=1S/C26H32N2O4/c1-3-4-15-31-21-7-5-19(6-8-21)18-28(20-11-13-27-14-12-20)24-17-26(29)32-25-10-9-22(30-2)16-23(24)25/h5-10,16-17,20,27H,3-4,11-15,18H2,1-2H3