5-(4-ethoxyphenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 5-(4-ethoxyphenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5-(4-ethoxyphenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5-(4-ethoxyphenyl)-4-(3-nitrophenyl)-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 5-(4-ethoxyphenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 4-(3-nitrophenyl)-5-p-phenetyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C21H15N5O3 MolecularWeight: 385.3755

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=C(C3=C2C(=NC=N3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=C(C3=C2C(=NC=N3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C21H15N5O3/c1-2-29-18-8-6-16(7-9-18)25-12-15(11-22)20-21(25)19(23-13-24-20)14-4-3-5-17(10-14)26(27)28/h3-10,12-13H,2H2,1H3