2-chloranyl-4-[(3-imidazol-1-ylpropylamino)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one

Systemtic Name: 2-chloranyl-4-[(3-imidazol-1-ylpropylamino)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 2-chloro-3-hydroxy-4-[(3-imidazol-1-ylpropylamino)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 2-chloro-3-hydroxy-4-[[3-(1-imidazolyl)propylamino]methyl]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 2-chloro-3-hydroxy-4-[(3-imidazol-1-ylpropylamino)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 2-chloro-3-hydroxy-4-[(3-imidazol-1-ylpropylamino)methyl]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC(=C(C(=C3OC2=O)CNCCCN4C=CN=C4)O)Cl

Isomeric SMILES

C1CCC2=C(C1)C3=CC(=C(C(=C3OC2=O)CNCCCN4C=CN=C4)O)Cl

InChI

InChI=1S/C20H22ClN3O3/c21-17-10-15-13-4-1-2-5-14(13)20(26)27-19(15)16(18(17)25)11-22-6-3-8-24-9-7-23-12-24/h7,9-10,12,22,25H,1-6,8,11H2