tert-butyl 4-[[6-[2-(cyclopentylmethylamino)-2-oxidanylidene-ethyl]-3-methanoyl-indol-1-yl]methyl]-3-methoxy-benzoate

Systemtic Name: tert-butyl 4-[[6-[2-(cyclopentylmethylamino)-2-oxidanylidene-ethyl]-3-methanoyl-indol-1-yl]methyl]-3-methoxy-benzoate Openeye Name: tert-butyl 4-[[6-[2-(cyclopentylmethylamino)-2-oxo-ethyl]-3-formyl-indol-1-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[6-[2-(cyclopentylmethylamino)-2-oxoethyl]-3-formyl-1-indolyl]methyl]-3-methoxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[6-[2-(cyclopentylmethylamino)-2-oxoethyl]-3-formylindol-1-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[6-[2-(cyclopentylmethylamino)-2-keto-ethyl]-3-formyl-indol-1-yl]methyl]-3-methoxy-benzoic acid tert-butyl ester Formula: C30H36N2O5 MolecularWeight: 504.61724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)CN2C=C(C3=C2C=C(C=C3)CC(=O)NCC4CCCC4)C=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)CN2C=C(C3=C2C=C(C=C3)CC(=O)NCC4CCCC4)C=O)OC

InChI

InChI=1S/C30H36N2O5/c1-30(2,3)37-29(35)22-10-11-23(27(15-22)36-4)17-32-18-24(19-33)25-12-9-21(13-26(25)32)14-28(34)31-16-20-7-5-6-8-20/h9-13,15,18-20H,5-8,14,16-17H2,1-4H3,(H,31,34)