2-[(2-chlorophenyl)methylcarbamoyl-(2-dimethylaminoethyloxymethyl)amino]ethyl N-isoquinolin-3-ylcarbamate

Systemtic Name: 2-[(2-chlorophenyl)methylcarbamoyl-(2-dimethylaminoethyloxymethyl)amino]ethyl N-isoquinolin-3-ylcarbamate Openeye Name: 2-[(2-chlorophenyl)methylcarbamoyl-(2-dimethylaminoethyloxymethyl)amino]ethyl N-(3-isoquinolyl)carbamate CAS Name: N-(3-isoquinolinyl)carbamic acid 2-[[[(2-chlorophenyl)methylamino]-oxomethyl]-(2-dimethylaminoethyloxymethyl)amino]ethyl ester IUPAC Name: 2-[(2-chlorophenyl)methylcarbamoyl-(2-dimethylaminoethyloxymethyl)amino]ethyl N-isoquinolin-3-ylcarbamate Traditional Name: N-(3-isoquinolyl)carbamic acid 2-[(2-chlorobenzyl)carbamoyl-(2-dimethylaminoethyloxymethyl)amino]ethyl ester Formula: C25H30ClN5O4 MolecularWeight: 499.9898

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOCN(CCOC(=O)NC1=CC2=CC=CC=C2C=N1)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CN(C)CCOCN(CCOC(=O)NC1=CC2=CC=CC=C2C=N1)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C25H30ClN5O4/c1-30(2)11-13-34-18-31(24(32)28-17-21-9-5-6-10-22(21)26)12-14-35-25(33)29-23-15-19-7-3-4-8-20(19)16-27-23/h3-10,15-16H,11-14,17-18H2,1-2H3,(H,28,32)(H,27,29,33)