heptyl 2-azanyl-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: heptyl 2-azanyl-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: heptyl 1-allyl-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid heptyl ester IUPAC Name: heptyl 2-amino-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-allyl-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid heptyl ester Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)N

Isomeric SMILES

CCCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)N

InChI

InChI=1S/C21H26N4O2/c1-3-5-6-7-10-14-27-21(26)17-18-20(25(13-4-2)19(17)22)24-16-12-9-8-11-15(16)23-18/h4,8-9,11-12H,2-3,5-7,10,13-14,22H2,1H3