1-(7-ethoxy-6-methoxy-1-methyl-3-oxidanylidene-2H-isoquinolin-4-yl)-3-prop-2-enyl-urea

Systemtic Name: 1-(7-ethoxy-6-methoxy-1-methyl-3-oxidanylidene-2H-isoquinolin-4-yl)-3-prop-2-enyl-urea Openeye Name: 1-allyl-3-(7-ethoxy-6-methoxy-1-methyl-3-oxo-2H-isoquinolin-4-yl)urea CAS Name: 1-(7-ethoxy-6-methoxy-1-methyl-3-oxo-2H-isoquinolin-4-yl)-3-prop-2-enylurea IUPAC Name: 1-(7-ethoxy-6-methoxy-1-methyl-3-oxo-2H-isoquinolin-4-yl)-3-prop-2-enylurea Traditional Name: 1-allyl-3-(7-ethoxy-3-keto-6-methoxy-1-methyl-2H-isoquinolin-4-yl)urea Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(NC(=O)C(=C2C=C1OC)NC(=O)NCC=C)C

Isomeric SMILES

CCOC1=CC2=C(NC(=O)C(=C2C=C1OC)NC(=O)NCC=C)C

InChI

InChI=1S/C17H21N3O4/c1-5-7-18-17(22)20-15-12-9-13(23-4)14(24-6-2)8-11(12)10(3)19-16(15)21/h5,8-9H,1,6-7H2,2-4H3,(H,19,21)(H2,18,20,22)