methyl 3-[4-[4-(7-methyl-2-oxidanylidene-chromen-4-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate

Systemtic Name: methyl 3-[4-[4-(7-methyl-2-oxidanylidene-chromen-4-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[4-[4-(7-methyl-2-oxo-chromen-4-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[4-(7-methyl-2-oxo-1-benzopyran-4-yl)-1-piperazinyl]butyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-[4-(7-methyl-2-oxochromen-4-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-[4-(2-keto-7-methyl-chromen-4-yl)piperazino]butyl]-1H-indole-5-carboxylic acid methyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)N3CCN(CC3)CCCCC4=CNC5=C4C=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)N3CCN(CC3)CCCCC4=CNC5=C4C=C(C=C5)C(=O)OC

InChI

InChI=1S/C28H31N3O4/c1-19-6-8-22-25(17-27(32)35-26(22)15-19)31-13-11-30(12-14-31)10-4-3-5-21-18-29-24-9-7-20(16-23(21)24)28(33)34-2/h6-9,15-18,29H,3-5,10-14H2,1-2H3