2-azanyl-5-[[3-(2-azanyl-3-oxidanyl-propanoyl)phenyl]methoxy]-1-methyl-indole-3-carbonitrile

Systemtic Name: 2-azanyl-5-[[3-(2-azanyl-3-oxidanyl-propanoyl)phenyl]methoxy]-1-methyl-indole-3-carbonitrile Openeye Name: 2-amino-5-[[3-(2-amino-3-hydroxy-propanoyl)phenyl]methoxy]-1-methyl-indole-3-carbonitrile CAS Name: 2-amino-5-[[3-(2-amino-3-hydroxy-1-oxopropyl)phenyl]methoxy]-1-methyl-3-indolecarbonitrile IUPAC Name: 2-amino-5-[[3-(2-amino-3-hydroxypropanoyl)phenyl]methoxy]-1-methylindole-3-carbonitrile Traditional Name: 2-amino-5-[3-(2-amino-3-hydroxy-propanoyl)benzyl]oxy-1-methyl-indole-3-carbonitrile Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OCC3=CC=CC(=C3)C(=O)C(CO)N)C(=C1N)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)OCC3=CC=CC(=C3)C(=O)C(CO)N)C(=C1N)C#N

InChI

InChI=1S/C20H20N4O3/c1-24-18-6-5-14(8-15(18)16(9-21)20(24)23)27-11-12-3-2-4-13(7-12)19(26)17(22)10-25/h2-8,17,25H,10-11,22-23H2,1H3