8-but-3-en-2-yl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-7-methoxy-6-nitro-quinazolin-4-amine

Systemtic Name: 8-but-3-en-2-yl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-7-methoxy-6-nitro-quinazolin-4-amine Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-7-methoxy-8-(1-methylallyl)-6-nitro-quinazolin-4-amine CAS Name: 8-but-3-en-2-yl-N-[(3-chloro-4-methoxyphenyl)methyl]-7-methoxy-6-nitro-4-quinazolinamine IUPAC Name: 8-but-3-en-2-yl-N-[(3-chloro-4-methoxyphenyl)methyl]-7-methoxy-6-nitroquinazolin-4-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-[7-methoxy-8-(1-methylallyl)-6-nitro-quinazolin-4-yl]amine Formula: C21H21ClN4O4 MolecularWeight: 428.86884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)C1=C2C(=CC(=C1OC)[N+](=O)[O-])C(=NC=N2)NCC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC(C=C)C1=C2C(=CC(=C1OC)[N+](=O)[O-])C(=NC=N2)NCC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H21ClN4O4/c1-5-12(2)18-19-14(9-16(26(27)28)20(18)30-4)21(25-11-24-19)23-10-13-6-7-17(29-3)15(22)8-13/h5-9,11-12H,1,10H2,2-4H3,(H,23,24,25)