methyl 4-[[5-azanyl-1-[3-(7-chloranylquinolin-2-yl)propyl]indol-3-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[5-azanyl-1-[3-(7-chloranylquinolin-2-yl)propyl]indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-amino-1-[3-(7-chloro-2-quinolyl)propyl]indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-amino-1-[3-(7-chloro-2-quinolinyl)propyl]-3-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-amino-1-[3-(7-chloroquinolin-2-yl)propyl]indol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[5-amino-1-[3-(7-chloro-2-quinolyl)propyl]indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C30H28ClN3O3 MolecularWeight: 514.01462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CC2=CN(C3=C2C=C(C=C3)N)CCCC4=NC5=C(C=CC(=C5)Cl)C=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CC2=CN(C3=C2C=C(C=C3)N)CCCC4=NC5=C(C=CC(=C5)Cl)C=C4

InChI

InChI=1S/C30H28ClN3O3/c1-36-29-15-21(30(35)37-2)6-5-20(29)14-22-18-34(28-12-10-24(32)17-26(22)28)13-3-4-25-11-8-19-7-9-23(31)16-27(19)33-25/h5-12,15-18H,3-4,13-14,32H2,1-2H3