2-[(E)-2-(3-bromophenyl)ethenyl]-5-chloranyl-1,3,3-trimethyl-2H-indole; N-methylmethanamine

Systemtic Name: 2-[(E)-2-(3-bromophenyl)ethenyl]-5-chloranyl-1,3,3-trimethyl-2H-indole; N-methylmethanamine Openeye Name: 2-[(E)-2-(3-bromophenyl)vinyl]-5-chloro-1,3,3-trimethyl-indoline; N-methylmethanamine CAS Name: 2-[(E)-2-(3-bromophenyl)ethenyl]-5-chloro-1,3,3-trimethyl-2H-indole; N-methylmethanamine IUPAC Name: 2-[(E)-2-(3-bromophenyl)ethenyl]-5-chloro-1,3,3-trimethyl-2H-indole; N-methylmethanamine Traditional Name: 2-[(E)-2-(3-bromophenyl)vinyl]-5-chloro-1,3,3-trimethyl-indoline; dimethylamine Formula: C21H26BrClN2 MolecularWeight: 421.80154

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C2=C1C=C(C=C2)Cl)C)C=CC3=CC(=CC=C3)Br)C.CNC

Isomeric SMILES

CC1(C(N(C2=C1C=C(C=C2)Cl)C)/C=C/C3=CC(=CC=C3)Br)C.CNC

InChI

InChI=1S/C19H19BrClN.C2H7N/c1-19(2)16-12-15(21)8-9-17(16)22(3)18(19)10-7-13-5-4-6-14(20)11-13;1-3-2/h4-12,18H,1-3H3;3H,1-2H3/b10-7+;