2-acetyloxyethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate; diphenylmethanone; methane

Systemtic Name: 2-acetyloxyethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate; diphenylmethanone; methane Openeye Name: 2-acetoxyethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate; diphenylmethanone; methane CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-acetyloxyethyl ester; diphenylmethanone; methane IUPAC Name: 2-acetyloxyethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate; diphenylmethanone; methane Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-acetoxyethyl ester; benzophenone; methane Formula: C30H37BrN2O5 MolecularWeight: 585.52918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23BrN2O4.C13H10O.CH4/c1-4-19(5-2)10-13-8-12(9-14(17)15(13)18)16(21)23-7-6-22-11(3)20;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h8-9H,4-7,10,18H2,1-3H3;1-10H;1H4