6-acetyloxyhexyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate; 2,6-bis(chloranyl)-N-phenyl-aniline

Systemtic Name: 6-acetyloxyhexyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate; 2,6-bis(chloranyl)-N-phenyl-aniline Openeye Name: 6-acetoxyhexyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate; 2,6-dichloro-N-phenyl-aniline CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 6-acetyloxyhexyl ester; 2,6-dichloro-N-phenylaniline IUPAC Name: 6-acetyloxyhexyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate; 2,6-dichloro-N-phenylaniline Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 6-acetoxyhexyl ester; (2,6-dichlorophenyl)-phenyl-amine Formula: C32H40BrCl2N3O4 MolecularWeight: 681.4877

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCCCCCOC(=O)C)Br)N.C1=CC=C(C=C1)NC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCCCCCOC(=O)C)Br)N.C1=CC=C(C=C1)NC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C20H31BrN2O4.C12H9Cl2N/c1-4-23(5-2)14-17-12-16(13-18(21)19(17)22)20(25)27-11-9-7-6-8-10-26-15(3)24;13-10-7-4-8-11(14)12(10)15-9-5-2-1-3-6-9/h12-13H,4-11,14,22H2,1-3H3;1-8,15H