ethyl 2-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]quinoline-4-carboxylate hydrochloride

Systemtic Name: ethyl 2-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]quinoline-4-carboxylate hydrochloride Openeye Name: ethyl 2-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]quinoline-4-carboxylate hydrochloride CAS Name: 2-[10-[3-(dimethylamino)propyl]-2-phenothiazinyl]-4-quinolinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]quinoline-4-carboxylate hydrochloride Traditional Name: 2-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]cinchoninic acid ethyl ester hydrochloride Formula: C29H30ClN3O2S MolecularWeight: 520.0854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC4=C(C=C3)SC5=CC=CC=C5N4CCCN(C)C.Cl

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC4=C(C=C3)SC5=CC=CC=C5N4CCCN(C)C.Cl

InChI

InChI=1S/C29H29N3O2S.ClH/c1-4-34-29(33)22-19-24(30-23-11-6-5-10-21(22)23)20-14-15-28-26(18-20)32(17-9-16-31(2)3)25-12-7-8-13-27(25)35-28;/h5-8,10-15,18-19H,4,9,16-17H2,1-3H3;1H