4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-8-ethyl-3-[(1-methylpyrrolidin-2-yl)methoxymethyl]quinoline-6-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-8-ethyl-3-[(1-methylpyrrolidin-2-yl)methoxymethyl]quinoline-6-carbonitrile Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-8-ethyl-3-[(1-methylpyrrolidin-2-yl)methoxymethyl]quinoline-6-carbonitrile CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-8-ethyl-3-[(1-methyl-2-pyrrolidinyl)methoxymethyl]-6-quinolinecarbonitrile IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-8-ethyl-3-[(1-methylpyrrolidin-2-yl)methoxymethyl]quinoline-6-carbonitrile Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-8-ethyl-3-[(1-methylpyrrolidin-2-yl)methoxymethyl]quinoline-6-carbonitrile Formula: C27H31ClN4O2 MolecularWeight: 479.01364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C(C(=CN=C12)COCC3CCCN3C)NCC4=CC(=C(C=C4)OC)Cl)C#N

Isomeric SMILES

CCC1=CC(=CC2=C(C(=CN=C12)COCC3CCCN3C)NCC4=CC(=C(C=C4)OC)Cl)C#N

InChI

InChI=1S/C27H31ClN4O2/c1-4-20-10-19(13-29)11-23-26(20)31-15-21(16-34-17-22-6-5-9-32(22)2)27(23)30-14-18-7-8-25(33-3)24(28)12-18/h7-8,10-12,15,22H,4-6,9,14,16-17H2,1-3H3,(H,30,31)