3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperazin-1-yl)propoxy]chromen-2-one

Systemtic Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperazin-1-yl)propoxy]chromen-2-one Openeye Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperazin-1-yl)propoxy]chromen-2-one CAS Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenyl-1-piperazinyl)propoxy]-1-benzopyran-2-one IUPAC Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperazin-1-yl)propoxy]chromen-2-one Traditional Name: 3-butyl-7-methoxy-4-methyl-6-[3-(4-phenylpiperazino)propoxy]coumarin Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC(=C(C=C2OC1=O)OC)OCCCN3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CCCCC1=C(C2=CC(=C(C=C2OC1=O)OC)OCCCN3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H36N2O4/c1-4-5-12-23-21(2)24-19-27(26(32-3)20-25(24)34-28(23)31)33-18-9-13-29-14-16-30(17-15-29)22-10-7-6-8-11-22/h6-8,10-11,19-20H,4-5,9,12-18H2,1-3H3