(phenylmethyl) 7-ethyl-6-methoxy-9-(phenylmethyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylate

Systemtic Name: (phenylmethyl) 7-ethyl-6-methoxy-9-(phenylmethyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylate Openeye Name: benzyl 9-benzyl-7-ethyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylate CAS Name: 7-ethyl-6-methoxy-9-(phenylmethyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-benzyl-7-ethyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylate Traditional Name: 9-benzyl-7-ethyl-6-methoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid benzyl ester Formula: C30H31NO3 MolecularWeight: 453.57204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)N(C3=C2C(CCC3)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)N(C3=C2C(CCC3)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C30H31NO3/c1-3-23-17-27-25(18-28(23)33-2)29-24(30(32)34-20-22-13-8-5-9-14-22)15-10-16-26(29)31(27)19-21-11-6-4-7-12-21/h4-9,11-14,17-18,24H,3,10,15-16,19-20H2,1-2H3