methyl 9-[[1-(cyclooctylmethyl)piperidin-4-yl]carbamoyl]-9H-xanthene-2-carboxylate

Systemtic Name: methyl 9-[[1-(cyclooctylmethyl)piperidin-4-yl]carbamoyl]-9H-xanthene-2-carboxylate Openeye Name: methyl 9-[[1-(cyclooctylmethyl)-4-piperidyl]carbamoyl]-9H-xanthene-2-carboxylate CAS Name: 9-[[[1-(cyclooctylmethyl)-4-piperidinyl]amino]-oxomethyl]-9H-xanthene-2-carboxylic acid methyl ester IUPAC Name: methyl 9-[[1-(cyclooctylmethyl)piperidin-4-yl]carbamoyl]-9H-xanthene-2-carboxylate Traditional Name: 9-[[1-(cyclooctylmethyl)-4-piperidyl]carbamoyl]-9H-xanthene-2-carboxylic acid methyl ester Formula: C30H38N2O4 MolecularWeight: 490.63372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3C2C(=O)NC4CCN(CC4)CC5CCCCCCC5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3C2C(=O)NC4CCN(CC4)CC5CCCCCCC5

InChI

InChI=1S/C30H38N2O4/c1-35-30(34)22-13-14-27-25(19-22)28(24-11-7-8-12-26(24)36-27)29(33)31-23-15-17-32(18-16-23)20-21-9-5-3-2-4-6-10-21/h7-8,11-14,19,21,23,28H,2-6,9-10,15-18,20H2,1H3,(H,31,33)