5-(2-chloroethyl)-1,4-dimethyl-7-phenylmethoxy-pyrimido[1,6-a]indole

Systemtic Name: 5-(2-chloroethyl)-1,4-dimethyl-7-phenylmethoxy-pyrimido[1,6-a]indole Openeye Name: 7-benzyloxy-5-(2-chloroethyl)-1,4-dimethyl-pyrimido[1,6-a]indole CAS Name: 5-(2-chloroethyl)-1,4-dimethyl-7-phenylmethoxypyrimido[1,6-a]indole IUPAC Name: 5-(2-chloroethyl)-1,4-dimethyl-7-phenylmethoxypyrimido[1,6-a]indole Traditional Name: 7-benzoxy-5-(2-chloroethyl)-1,4-dimethyl-pyrimid[1,6-a]indole Formula: C22H21ClN2O MolecularWeight: 364.86794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N2C1=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)CCCl)C

Isomeric SMILES

CC1=CN=C(N2C1=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)CCCl)C

InChI

InChI=1S/C22H21ClN2O/c1-15-13-24-16(2)25-21-9-8-18(26-14-17-6-4-3-5-7-17)12-20(21)19(10-11-23)22(15)25/h3-9,12-13H,10-11,14H2,1-2H3