2-[[(3R)-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(3R)-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(3R)-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3R)-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(3R)-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)propanoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(3R)-3-(4-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-ammonium Formula: C23H29ClN3O+ MolecularWeight: 398.94886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)NCC[NH+](C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2[C@H](CC(=O)NCC[NH+](C)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O/c1-4-16-6-5-7-19-21(15-26-23(16)19)20(17-8-10-18(24)11-9-17)14-22(28)25-12-13-27(2)3/h5-11,15,20,26H,4,12-14H2,1-3H3,(H,25,28)/p+1/t20-/m1/s1