[4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-ethyl-azanium

Systemtic Name: [4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-ethyl-azanium Openeye Name: [4-[2-(4-bromoanilino)-2-oxo-ethoxy]-3-methoxy-phenyl]methyl-ethyl-ammonium CAS Name: [4-[2-(4-bromoanilino)-2-oxoethoxy]-3-methoxyphenyl]methyl-ethylammonium IUPAC Name: [4-[2-(4-bromoanilino)-2-oxoethoxy]-3-methoxyphenyl]methyl-ethylazanium Traditional Name: [4-[2-(4-bromoanilino)-2-keto-ethoxy]-3-methoxy-benzyl]-ethyl-ammonium Formula: C18H22BrN2O3+ MolecularWeight: 394.28288

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)Br)OC

Isomeric SMILES

CC[NH2+]CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C18H21BrN2O3/c1-3-20-11-13-4-9-16(17(10-13)23-2)24-12-18(22)21-15-7-5-14(19)6-8-15/h4-10,20H,3,11-12H2,1-2H3,(H,21,22)/p+1