4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one

Systemtic Name: 4-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one Openeye Name: 4-(3-bromo-4-ethoxy-5-methoxy-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one CAS Name: 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one IUPAC Name: 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one Traditional Name: 4-(3-bromo-4-ethoxy-5-methoxy-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C2C3=C(C4=CC=CC=C4CC3)NC(=O)N2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C2C3=C(C4=CC=CC=C4CC3)NC(=O)N2)OC

InChI

InChI=1S/C21H21BrN2O3/c1-3-27-20-16(22)10-13(11-17(20)26-2)18-15-9-8-12-6-4-5-7-14(12)19(15)24-21(25)23-18/h4-7,10-11,18H,3,8-9H2,1-2H3,(H2,23,24,25)