(phenylmethyl) 8-chloranyl-6-hexoxy-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylate

Systemtic Name: (phenylmethyl) 8-chloranyl-6-hexoxy-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylate Openeye Name: benzyl 8-chloro-6-hexoxy-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylate CAS Name: 8-chloro-6-hexoxy-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 8-chloro-6-hexoxy-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylate Traditional Name: 8-chloro-6-hexoxy-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylic acid benzyl ester Formula: C26H30ClNO3 MolecularWeight: 439.9743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C2C(=C1)C3=C(N2)CCCC3C(=O)OCC4=CC=CC=C4)Cl

Isomeric SMILES

CCCCCCOC1=CC(=C2C(=C1)C3=C(N2)CCCC3C(=O)OCC4=CC=CC=C4)Cl

InChI

InChI=1S/C26H30ClNO3/c1-2-3-4-8-14-30-19-15-21-24-20(26(29)31-17-18-10-6-5-7-11-18)12-9-13-23(24)28-25(21)22(27)16-19/h5-7,10-11,15-16,20,28H,2-4,8-9,12-14,17H2,1H3