(2S)-1-[(2S)-2-azanyl-3-(5-ethoxy-1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[(2S)-2-azanyl-3-(5-ethoxy-1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[(2S)-2-amino-3-(5-ethoxy-1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[(2S)-2-amino-3-(5-ethoxy-1H-indol-3-yl)-1-oxopropyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[(2S)-2-amino-3-(5-ethoxy-1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[(2S)-2-amino-3-(5-ethoxy-1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonitrile Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC=C2CC(C(=O)N3CCCC3C#N)N

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC=C2C[C@@H](C(=O)N3CCC[C@H]3C#N)N

InChI

InChI=1S/C18H22N4O2/c1-2-24-14-5-6-17-15(9-14)12(11-21-17)8-16(20)18(23)22-7-3-4-13(22)10-19/h5-6,9,11,13,16,21H,2-4,7-8,20H2,1H3/t13-,16-/m0/s1