methyl 4-[[2-(bromomethyl)-3-chloranyl-5-(cyclopentylcarbonylamino)indol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[2-(bromomethyl)-3-chloranyl-5-(cyclopentylcarbonylamino)indol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[2-(bromomethyl)-3-chloro-5-(cyclopentanecarbonylamino)indol-1-yl]methyl]benzoate CAS Name: 4-[[2-(bromomethyl)-3-chloro-5-[[cyclopentyl(oxo)methyl]amino]-1-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(bromomethyl)-3-chloro-5-(cyclopentanecarbonylamino)indol-1-yl]methyl]benzoate Traditional Name: 4-[[2-(bromomethyl)-3-chloro-5-(cyclopentanecarbonylamino)indol-1-yl]methyl]benzoic acid methyl ester Formula: C24H24BrClN2O3 MolecularWeight: 503.81596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC(=O)C4CCCC4)C(=C2CBr)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC(=O)C4CCCC4)C(=C2CBr)Cl

InChI

InChI=1S/C24H24BrClN2O3/c1-31-24(30)17-8-6-15(7-9-17)14-28-20-11-10-18(12-19(20)22(26)21(28)13-25)27-23(29)16-4-2-3-5-16/h6-12,16H,2-5,13-14H2,1H3,(H,27,29)