[(4S)-4-[(6-chloranyl-2-methoxy-acridin-9-yl)-(2-phenylethanoyl)amino]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[(6-chloranyl-2-methoxy-acridin-9-yl)-(2-phenylethanoyl)amino]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[(6-chloro-2-methoxy-acridin-9-yl)-(2-phenylacetyl)amino]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[(6-chloro-2-methoxy-9-acridinyl)-(1-oxo-2-phenylethyl)amino]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[(6-chloro-2-methoxyacridin-9-yl)-(2-phenylacetyl)amino]pentyl]-diethylazanium Traditional Name: [(4S)-4-[(6-chloro-2-methoxy-acridin-9-yl)-(2-phenylacetyl)amino]pentyl]-diethyl-ammonium Formula: C31H37ClN3O2+ MolecularWeight: 519.09738

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)N(C1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)N(C1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C31H36ClN3O2/c1-5-34(6-2)18-10-11-22(3)35(30(36)19-23-12-8-7-9-13-23)31-26-16-14-24(32)20-29(26)33-28-17-15-25(37-4)21-27(28)31/h7-9,12-17,20-22H,5-6,10-11,18-19H2,1-4H3/p+1/t22-/m0/s1