2-acetyloxyethyl 4-azanyl-3-bromanyl-5-[[cyclopentyl(ethyl)amino]methyl]benzoate; diphenylmethanone; methane

Systemtic Name: 2-acetyloxyethyl 4-azanyl-3-bromanyl-5-[[cyclopentyl(ethyl)amino]methyl]benzoate; diphenylmethanone; methane Openeye Name: 2-acetoxyethyl 4-amino-3-bromo-5-[[cyclopentyl(ethyl)amino]methyl]benzoate; diphenylmethanone; methane CAS Name: 4-amino-3-bromo-5-[[cyclopentyl(ethyl)amino]methyl]benzoic acid 2-acetyloxyethyl ester; diphenylmethanone; methane IUPAC Name: 2-acetyloxyethyl 4-amino-3-bromo-5-[[cyclopentyl(ethyl)amino]methyl]benzoate; diphenylmethanone; methane Traditional Name: 4-amino-3-bromo-5-[[cyclopentyl(ethyl)amino]methyl]benzoic acid 2-acetoxyethyl ester; benzophenone; methane Formula: C33H41BrN2O5 MolecularWeight: 625.59304

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Descriptors Computed from Structure

Canonical SMILES:

C.CCN(CC1=C(C(=CC(=C1)C(=O)OCCOC(=O)C)Br)N)C2CCCC2.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

C.CCN(CC1=C(C(=CC(=C1)C(=O)OCCOC(=O)C)Br)N)C2CCCC2.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H27BrN2O4.C13H10O.CH4/c1-3-22(16-6-4-5-7-16)12-15-10-14(11-17(20)18(15)21)19(24)26-9-8-25-13(2)23;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h10-11,16H,3-9,12,21H2,1-2H3;1-10H;1H4