2-[4-[(1H-indol-3-ylcarbonylamino)methyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-[(1H-indol-3-ylcarbonylamino)methyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[(1H-indole-3-carbonylamino)methyl]-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[[[1H-indol-3-yl(oxo)methyl]amino]methyl]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[(1H-indole-3-carbonylamino)methyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-[(1H-indole-3-carbonylamino)methyl]piperidino]ethyl ester Formula: C25H29ClN4O4 MolecularWeight: 484.97516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)CNC(=O)C3=CNC4=CC=CC=C43)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)CNC(=O)C3=CNC4=CC=CC=C43)Cl)N

InChI

InChI=1S/C25H29ClN4O4/c1-33-23-13-21(27)20(26)12-18(23)25(32)34-11-10-30-8-6-16(7-9-30)14-29-24(31)19-15-28-22-5-3-2-4-17(19)22/h2-5,12-13,15-16,28H,6-11,14,27H2,1H3,(H,29,31)