methyl 3-[4-[4-(7-chloranyl-2-oxidanylidene-chromen-6-yl)piperazin-1-yl]butyl]-1H-indole-6-carboxylate

Systemtic Name: methyl 3-[4-[4-(7-chloranyl-2-oxidanylidene-chromen-6-yl)piperazin-1-yl]butyl]-1H-indole-6-carboxylate Openeye Name: methyl 3-[4-[4-(7-chloro-2-oxo-chromen-6-yl)piperazin-1-yl]butyl]-1H-indole-6-carboxylate CAS Name: 3-[4-[4-(7-chloro-2-oxo-1-benzopyran-6-yl)-1-piperazinyl]butyl]-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-[4-(7-chloro-2-oxochromen-6-yl)piperazin-1-yl]butyl]-1H-indole-6-carboxylate Traditional Name: 3-[4-[4-(7-chloro-2-keto-chromen-6-yl)piperazino]butyl]-1H-indole-6-carboxylic acid methyl ester Formula: C27H28ClN3O4 MolecularWeight: 493.98192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=CN2)CCCCN3CCN(CC3)C4=C(C=C5C(=C4)C=CC(=O)O5)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=CN2)CCCCN3CCN(CC3)C4=C(C=C5C(=C4)C=CC(=O)O5)Cl

InChI

InChI=1S/C27H28ClN3O4/c1-34-27(33)19-5-7-21-20(17-29-23(21)14-19)4-2-3-9-30-10-12-31(13-11-30)24-15-18-6-8-26(32)35-25(18)16-22(24)28/h5-8,14-17,29H,2-4,9-13H2,1H3